HMDB0241440 RDKit 3D (6Z)-Pentadec-6-enoylcarnitine 68 67 0 0 0 0 0 0 0 0999 V2000 9.7765 -0.7298 2.5807 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7226 -0.0249 1.6553 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8890 -0.6499 0.3377 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1349 -0.1229 -0.8036 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6727 -0.0858 -0.7379 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0723 0.8753 0.1961 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5481 0.7729 0.1496 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9879 1.0703 -1.2135 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5096 0.9493 -1.0979 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 0.0589 -1.8463 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3832 -0.1072 -1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1789 0.8572 -0.7665 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6694 0.7014 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3886 0.9558 -1.9534 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8495 0.7812 -1.7472 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6877 0.9384 -2.6714 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3131 0.4361 -0.5089 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6818 0.2432 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9628 1.2078 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7468 2.6257 0.6161 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3665 2.9640 -0.5145 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9704 3.5963 1.5722 O 0 0 0 0 0 1 0 0 0 0 0 0 -5.9001 -1.1777 0.3093 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2421 -1.5172 0.6524 N 0 0 0 0 0 4 0 0 0 0 0 0 -8.2321 -0.9153 -0.2126 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4493 -2.9806 0.4696 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6063 -1.2333 2.0219 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8975 -0.1066 3.4654 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3884 -1.7348 2.7485 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7172 -0.7912 2.0235 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7358 -0.2869 2.1268 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8761 1.0437 1.7491 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9996 -0.7209 0.0629 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6571 -1.7696 0.4758 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5349 0.9493 -1.0153 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4942 -0.6295 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3086 0.0945 -1.7975 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2265 -1.1006 -0.5134 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2954 1.9353 -0.1914 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3542 0.8880 1.2178 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2549 -0.2451 0.4263 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1508 1.4600 0.8972 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2909 2.0768 -1.5787 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3495 0.3255 -1.9579 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9797 1.5716 -0.4239 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4255 -0.5750 -2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0316 0.0222 -2.7835 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2225 -1.1550 -1.4456 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0594 1.9061 -1.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2349 0.5708 0.2326 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8885 -0.3465 -0.3396 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0486 1.3453 0.1612 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 2.0037 -2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0266 0.2983 -2.7523 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2980 0.4764 -1.0412 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9974 1.1437 1.3563 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2613 0.9893 1.8185 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 -1.3139 1.2294 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4990 -1.9090 -0.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8174 -0.8599 -1.2409 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1009 -1.6307 -0.3086 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6731 0.0093 0.1557 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4432 -3.2060 0.8602 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4592 -3.1183 -0.6296 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6196 -3.5029 0.9544 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4928 -0.5623 2.0496 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9361 -2.1810 2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7453 -0.8531 2.6149 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 3 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 18 23 1 0 23 24 1 0 24 25 1 0 24 26 1 0 24 27 1 0 1 28 1 0 1 29 1 0 1 30 1 0 2 31 1 0 2 32 1 0 3 33 1 0 3 34 1 0 4 35 1 0 4 36 1 0 5 37 1 0 5 38 1 0 6 39 1 0 6 40 1 0 7 41 1 0 7 42 1 0 8 43 1 0 8 44 1 0 9 45 1 0 10 46 1 0 11 47 1 0 11 48 1 0 12 49 1 0 12 50 1 0 13 51 1 0 13 52 1 0 14 53 1 0 14 54 1 0 18 55 1 0 19 56 1 0 19 57 1 0 23 58 1 0 23 59 1 0 25 60 1 0 25 61 1 0 25 62 1 0 26 63 1 0 26 64 1 0 26 65 1 0 27 66 1 0 27 67 1 0 27 68 1 0 M CHG 2 22 -1 24 1 M END